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Issue Date
Title
Author(s)
17-Jun-2015
Binding specificity of polypeptide substrates in NS2B/NS3pro serine protease of dengue virus type 2: A molecular dynamics Study
Pathumwadee Yotmanee
;
Thanyada Rungrotmongkol
;
Kanin Wichapong
;
Sy Bing Choi
;
Habibah A. Wahab
;
Nawee Kungwan
;
Supot Hannongbua
1-Apr-2016
How strong is the edge effect in the adsorption of anticancer drugs on a graphene cluster?
Chompoonut Rungnim
;
Rungroj Chanajaree
;
Thanyada Rungrotmongkol
;
Supot Hannongbua
;
Nawee Kungwan
;
Peter Wolschann
;
Alfred Karpfen
;
Vudhichai Parasuk
1-Jan-2016
Inclusion complexation of pinostrobin with various cyclodextrin derivatives
Jintawee Kicuntod
;
Wasinee Khuntawee
;
Peter Wolschann
;
Piamsook Pongsawasdi
;
Warinthorn Chavasiri
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
1-Oct-2016
Role of R292K mutation in influenza H7N9 neuraminidase toward oseltamivir susceptibility: MD and MM/PB(GB)SA study
Jiraphorn Phanich
;
Thanyada Rungrotmongkol
;
Nawee Kungwan
;
Supot Hannongbua
1-Jan-2018
Molecular insights into inclusion complexes of mansonone E and H enantiomers with various β-cyclodextrins
Panupong Mahalapbutr
;
Bodee Nutho
;
Peter Wolschann
;
Warinthorn Chavasiri
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
24-Apr-2017
Comparison of Implicit and Explicit Solvation Models for Iota-Cyclodextrin Conformation Analysis from Replica Exchange Molecular Dynamics
Wasinee Khuntawee
;
Manaschai Kunaseth
;
Chompoonut Rungnim
;
Suradej Intagorn
;
Peter Wolschann
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
;
Supot Hannongbua
1-Jan-2017
Structural dynamics and binding free energy of neral-cyclodextrins inclusion complexes: Molecular dynamics simulation
Peerapong Wongpituk
;
Bodee Nutho
;
Wanwisa Panman
;
Nawee Kungwan
;
Peter Wolschann
;
Thanyada Rungrotmongkol
;
Nadtanet Nunthaboot
1-Jun-2019
Low susceptibility of asunaprevir towards R155K and D168A point mutations in HCV NS3/4A protease: A molecular dynamics simulation
Jirayu Kammarabutr
;
Panupong Mahalapbutr
;
Bodee Nutho
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
Discover
Author
1
Habibah A. Wahab
1
Jintawee Kicuntod
1
Jiraphorn Phanich
1
Jirayu Kammarabutr
1
Kanin Wichapong
1
Manaschai Kunaseth
1
Nadtanet Nunthaboot
1
Pathumwadee Yotmanee
1
Peerapong Wongpituk
1
Piamsook Pongsawasdi
.
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Materials Science
3
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Pharmacology, Toxicology and Phar...
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